(4-aminocarbonyl-2-nitro-phenyl)methyl 4-(4-chloranyl-2-nitro-phenoxy)benzoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 4-(4-chloranyl-2-nitro-phenoxy)benzoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 4-(4-chloro-2-nitro-phenoxy)benzoate CAS Name: 4-(4-chloro-2-nitrophenoxy)benzoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 4-(4-chloro-2-nitrophenoxy)benzoate Traditional Name: 4-(4-chloro-2-nitro-phenoxy)benzoic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C21H14ClN3O8 MolecularWeight: 471.80416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])OC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])OC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H14ClN3O8/c22-15-5-8-19(18(10-15)25(30)31)33-16-6-3-12(4-7-16)21(27)32-11-14-2-1-13(20(23)26)9-17(14)24(28)29/h1-10H,11H2,(H2,23,26)